potassium (2S,5R,6R)-3,3-dimethyl-7-oxidanylidene-6-[(2-phenoxy-2-phenyl-ethanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: potassium (2S,5R,6R)-3,3-dimethyl-7-oxidanylidene-6-[(2-phenoxy-2-phenyl-ethanoyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: potassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxy-2-phenyl-acetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: potassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenoxy-2-phenylethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: potassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxy-2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: potassium (2S,5R,6R)-7-keto-3,3-dimethyl-6-[(2-phenoxy-2-phenyl-acetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C22H22KN2O5S+ MolecularWeight: 465.58378

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)OC4=CC=CC=C4)C(=O)O)C.[K+]

Isomeric SMILES

CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)OC4=CC=CC=C4)C(=O)O)C.[K+]

InChI

InChI=1S/C22H22N2O5S.K/c1-22(2)17(21(27)28)24-19(26)15(20(24)30-22)23-18(25)16(13-9-5-3-6-10-13)29-14-11-7-4-8-12-14;/h3-12,15-17,20H,1-2H3,(H,23,25)(H,27,28);/q;+1/t15-,16?,17+,20-;/m1./s1